(4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride

C15H16ClF2N5 — CID 160903843

IUPAC(4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride
SMILESCl.NNc1ccc(F)cc1.Nc1ccnn1-c1ccc(F)cc1
InChIInChI=1S/C9H8FN3.C6H7FN2.ClH/c10-7-1-3-8(4-2-7)13-9(11)5-6-12-13;7-5-1-3-6(9-8)4-2-5;/h1-6H,11H2;1-4,9H,8H2;1H
InChIKeySPWCTLKHOUCROY-UHFFFAOYSA-N
MW339.78 g/mol
LogP3.13
Rot. Bonds2

About (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride

(4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride (PubChem CID 160903843) has the molecular formula C15H16ClF2N5 and a molecular weight of 339.78 g/mol. Its IUPAC name is (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride.

Molecular Properties

Compound Name(4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride
PubChem CID160903843
Molecular FormulaC15H16ClF2N5
Molecular Weight339.78 g/mol
Exact Mass339.11
IUPAC Name(4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride
SMILESCl.NNc1ccc(F)cc1.Nc1ccnn1-c1ccc(F)cc1
InChIInChI=1S/C9H8FN3.C6H7FN2.ClH/c10-7-1-3-8(4-2-7)13-9(11)5-6-12-13;7-5-1-3-6(9-8)4-2-5;/h1-6H,11H2;1-4,9H,8H2;1H
InChIKeySPWCTLKHOUCROY-UHFFFAOYSA-N
XLogP3.13
TPSA81.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.78
LogP ≤ 53.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-Phenylpyrazol-5-ylamine
CID 70006
5-amino-1-(4-fluorophenyl)-1H-pyrazole-4-carbonitrile
CID 688685
1-phenyl-1H-pyrazol-3-amine
CID 594320
1-phenyl-1H-pyrazol-3-amine hydrochloride
CID 2860831
4-methyl-1-phenyl-1H-pyrazol-5-amine
CID 61393325
1-(4-Fluorophenyl)-4-[(2-fluorophenyl)diazenyl]pyrazole-3,5-diamine
CID 162739697
4-iodo-1-phenyl-1H-pyrazol-5-amine
CID 80364478
1-(2-Fluorophenyl)-1H-pyrazol-3-amine
CID 9990807
1-(4-fluorophenyl)-1H-pyrazol-5-amine
CID 12763782
1-(4-(Trifluoromethyl)phenyl)-1H-pyrazol-5-amine
CID 12763784
1-(4-fluorophenyl)-1H-pyrazol-3-amine
CID 13626944
5-Amino-1-(3-fluorophenyl)-1H-pyrazole-4-carbonitrile
CID 15698847

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride?
The IUPAC name of (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride (CID 160903843) is (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride.
What is the SMILES notation for (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride?
The canonical SMILES for (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride is Cl.NNc1ccc(F)cc1.Nc1ccnn1-c1ccc(F)cc1.
What is the InChIKey of (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride?
The InChIKey is SPWCTLKHOUCROY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FN3.C6H7FN2.ClH/c10-7-1-3-8(4-2-7)13-9(11)5-6-12-13;7-5-1-3-6(9-8)4-2-5;/h1-6H,11H2;1-4,9H,8H2;1H.
What are the key properties of (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride?
(4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride has a molecular weight of 339.78 g/mol, XLogP of 3.13, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)hydrazine;2-(4-fluorophenyl)pyrazol-3-amine;hydrochloride is sourced from PubChem (CID 160903843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).